SCHEMBL23712366

SCHEMBL23712366

CS1(C)CCN(NC(=O)c2cc3c(F)cc(F)cc3[nH]2)CC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.42
HRH4 Q9H3N8 8/20 0.41
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
EIF4A3 P38919 1/20 0.38
SLC2A1 P11166 1/20 0.36
GHSR Q92847 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
FBP1 P09467 1/20 0.33
SETD2 Q9BYW2 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30556358 0.83 CNR1 (0.42) CNR1HRH4CYP2D6CYP2C9CYP2C19
SCHEMBL23111898 0.83 CNR1 (0.42) CNR1HRH4CYP2D6CYP2C9CYP2C19
SCHEMBL30556366 0.83 CNR1 (0.42) CNR1HRH4CYP2D6CYP2C9CYP2C19
SCHEMBL23111896 0.83 CNR1 (0.42) CNR1HRH4CYP2D6CYP2C9CYP2C19
SCHEMBL23712320 0.81 HRH4 (0.54) HRH4
SCHEMBL23712343 0.79 GRIN1 (0.50) HRH4EIF4A3MEN1KMT2A
SCHEMBL23712332 0.79 MLLT1 (0.49) CNR1EIF4A3SLC2A1GHSRSETD2
SCHEMBL18183345 0.75 CNR1 (0.48) CNR1HRH4CYP2C19EIF4A3SLC2A1
SCHEMBL23712330 0.74 HRH4 (0.55) HRH4
SCHEMBL29655554 0.71 CNR1 (0.46) CNR1CYP2C19EIF4A3SLC2A1GHSR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718633-B2 Indole compounds, process for the preparation and use thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2023-08-08 US disclosed
US-20210238204-A1 INDOLE COMPOUNDS, PROCESS FOR THE PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2021-08-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11718633-B2 Indole compounds, process for the preparation and use thereof IDO1, IDO2, INMT CNR1 603/4885HRH4 1210/4885CYP2D6 147/4885
US-20210238204-A1 INDOLE COMPOUNDS, PROCESS FOR THE PREPARATION AND USE THEREOF IDO1, IDO2, INMT CNR1 603/4885HRH4 1210/4885CYP2D6 147/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.